4-{6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl}butan-2-one
4-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)butan-2-one
Also Known As: .alpha.-Pinene, 10-(2-oxopropyl)-|4-{6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl}butan-2-one|4-(6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl)butan-2-one|4-(6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl)-2-butanone #
CAS: 56933-99-4
| Molecular Formula | C13H20O |
|---|---|
| Molecular Weight | 192.15141 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.15141 |
| Monoisotopic Mass | 192.15141 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 56933-99-4 |
|---|---|
| SMILES | CC(=O)CCC1=CCC2CC1C2(C)C |
| InChIKey | LHWRJGXMTVYJHO-UHFFFAOYSA-N |
Product Overview
4-{6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl}butan-2-one (CAS 56933-99-4), with molecular formula C13H20O and molecular weight 192.15141 g/mol. IUPAC: 4-(6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl)butan-2-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4-{6,6-Dimethylbicyclo[3.1.1]hept-2-en-2-yl}butan-2-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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